CID 207486

6-(2-(1-methyl-2-piperidyl)ethyl)-5,7,12,13-tetrahydro-6h-dibenz(c,g)azonine hydrochloride

Structural Information

Molecular Formula
C24H32N2
SMILES
CN1CCCCC1CCN2CC3=CC=CC=C3CCC4=CC=CC=C4C2
InChI
InChI=1S/C24H32N2/c1-25-16-7-6-12-24(25)15-17-26-18-22-10-4-2-8-20(22)13-14-21-9-3-5-11-23(21)19-26/h2-5,8-11,24H,6-7,12-19H2,1H3
InChIKey
UYFOQDQKARZPMU-UHFFFAOYSA-N
Compound name
6-[2-(1-methylpiperidin-2-yl)ethyl]-5,7,12,13-tetrahydrobenzo[d][2]benzazonine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.25656 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.26384 198.0
[M+Na]+ 371.24578 195.1
[M-H]- 347.24928 196.0
[M+NH4]+ 366.29038 196.2
[M+K]+ 387.21972 195.1
[M+H-H2O]+ 331.25382 187.5
[M+HCOO]- 393.25476 196.8
[M+CH3COO]- 407.27041 197.4
[M+Na-2H]- 369.23123 198.2
[M]+ 348.25601 196.4
[M]- 348.25711 196.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.